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DocumentationIdentifier: MM242464
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM242464 |
| SMILES |
CC(N)(CN)C(O)C=CF
|
| InChIKey |
QDTFSIZHTVGRMR-UHFFFAOYSA-N
|
| MW [Da] |
148.18
Automatically obtained from RDkit software. |
| LogP |
-0.49
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
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MM233232
Similarity: 0.6211
Similarity to MM233232
| Tanimoto metric | 0.6211 |
|---|---|
| Cosine metric | 0.7663 |
| Dice metric | 0.7662 |
| MW: | 144.22 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.53 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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| Cosine metric | 0.7641 |
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| MW: | 151.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
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| LogP: | 0.87 |
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Total active interactions
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| Tanimoto metric | 0.6053 |
|---|---|
| Cosine metric | 0.778 |
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||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.43 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+249 more
